C.I. Reactive Orange 4
TL;DR: C.I. Reactive Orange 4 (CAS 70616-90-9) is a chemical compound with molecular formula C24H13Cl2N6Na3O10S3 and molecular weight 779.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trisodium;2-[[6-[(4,6-dichloro-1,3,5-triazin-2-yl)-methylamino]-1-hydroxy-3-sulfonatonaphthalen-2-yl]diazenyl]naphthalene-1,5-disulfonate
Also Known As: C.I. Reactive Orange 4, Reactive Orange 4, C.I.Reactive Orange 4, trisodium;2-[[6-[(4,6-dichloro-1,3,5-triazin-2-yl)-methylamino]-1-hydroxy-3-sulfonatonaphthalen-2-yl]diazenyl]naphthalene-1,5-disulfonate, 1,5-Naphthalenedisulfonic acid, 2-((6-((4,6-dichloro-1,3,5-triazin-2-yl)methylamino)-1-hydroxy-3-sulfo-2-naphthalenyl)azo)-, trisodium salt
| Molecular Formula | C24H13Cl2N6Na3O10S3 |
|---|---|
| Molecular Weight | 779.89 g/mol |
| LogP | -4.9 |
| Topological Polar Surface Area | 284.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 4 |
| Exact Mass | 779.8925 |
| Heavy Atoms | 48 |
| Complexity | 1380.0 |
Chemical Identifiers
| CAS Number | 70616-90-9 |
|---|---|
| SMILES | CN(C1=CC2=CC(=C(C(=C2C=C1)O)N=NC3=C(C4=C(C=C3)C(=CC=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])C5=NC(=NC(=N5)Cl)Cl.[Na+].[Na+].[Na+] |
| InChIKey | ARXWHYHTMGGNST-UHFFFAOYSA-K |
Product Overview
C.I. Reactive Orange 4 (CAS 70616-90-9), with molecular formula C24H13Cl2N6Na3O10S3 and molecular weight 779.89 g/mol. IUPAC: trisodium;2-[[6-[(4,6-dichloro-1,3,5-triazin-2-yl)-methylamino]-1-hydroxy-3-sulfonatonaphthalen-2-yl]diazenyl]naphthalene-1,5-disulfonate.
Chemical Property Profile of C.I. Reactive Orange 4
Property Insights of C.I. Reactive Orange 4
The XLogP value of -4.9 indicates that C.I. Reactive Orange 4 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 284.0 Ų indicates high polarity, suggesting C.I. Reactive Orange 4 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C.I. Reactive Orange 4 has 1 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C.I. Reactive Orange 4?
The CAS number of C.I. Reactive Orange 4 is 70616-90-9.
What is the molecular formula of C.I. Reactive Orange 4?
The molecular formula of C.I. Reactive Orange 4 is C24H13Cl2N6Na3O10S3.
What is the molecular weight of C.I. Reactive Orange 4?
The molecular weight of C.I. Reactive Orange 4 is 779.89 g/mol.
Where can I buy C.I. Reactive Orange 4?
You can request a quote for C.I. Reactive Orange 4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C.I. Reactive Orange 4?
Yes, KEHONG BIO provides custom synthesis services for C.I. Reactive Orange 4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.